CID 736143
Phenyl trans-styryl sulfone
Structural Information
- Molecular Formula
- C14H12O2S
- SMILES
- C1=CC=C(C=C1)/C=C/S(=O)(=O)C2=CC=CC=C2
- InChI
- InChI=1S/C14H12O2S/c15-17(16,14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+
- InChIKey
- DNMCCXFLTURVLK-VAWYXSNFSA-N
- Compound name
- [(E)-2-(benzenesulfonyl)ethenyl]benzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 245.06308 | 153.6 |
[M+Na]+ | 267.04502 | 167.9 |
[M+NH4]+ | 262.08962 | 162.4 |
[M+K]+ | 283.01896 | 158.0 |
[M-H]- | 243.04852 | 157.6 |
[M+Na-2H]- | 265.03047 | 163.2 |
[M]+ | 244.05525 | 157.4 |
[M]- | 244.05635 | 157.4 |